2,5-环己二烯-1,4-二亚胺
TL;DR: 2,5-环己二烯-1,4-二亚胺 (CAS 4377-73-5) is a chemical compound with molecular formula C6H6N2 and molecular weight 106.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-环己二烯-1,4-二亚胺
cyclohexa-2,5-diene-1,4-diimine
Also Known As: p-Benzoquinone diimine, benzoquinone diimine, 1,4-benzoquinone diimine, 2,5-Cyclohexadiene-1,4-diimine, cyclohexa-2,5-diene-1,4-diimine
| Molecular Formula | C6H6N2 |
|---|---|
| Molecular Weight | 106.05 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 47.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 106.0531 |
| Heavy Atoms | 8 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 4377-73-5 |
|---|---|
| SMILES | C1=CC(=N)C=CC1=N |
| InChIKey | ACFNYGLBKAZUDY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-环己二烯-1,4-二亚胺 (CAS 4377-73-5), with molecular formula C6H6N2 and molecular weight 106.05 g/mol. IUPAC: cyclohexa-2,5-diene-1,4-diimine.
Chemical Property Profile of 2,5-环己二烯-1,4-二亚胺
Property Insights of 2,5-环己二烯-1,4-二亚胺
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-环己二烯-1,4-二亚胺. With a topological polar surface area (TPSA) of 47.7 Ų, 2,5-环己二烯-1,4-二亚胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-环己二烯-1,4-二亚胺 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,5-环己二烯-1,4-二亚胺?
The CAS number of 2,5-环己二烯-1,4-二亚胺 is 4377-73-5.
What is the molecular formula of 2,5-环己二烯-1,4-二亚胺?
The molecular formula of 2,5-环己二烯-1,4-二亚胺 is C6H6N2.
What is the molecular weight of 2,5-环己二烯-1,4-二亚胺?
The molecular weight of 2,5-环己二烯-1,4-二亚胺 is 106.05 g/mol.
Where can I buy 2,5-环己二烯-1,4-二亚胺?
You can request a quote for 2,5-环己二烯-1,4-二亚胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-环己二烯-1,4-二亚胺?
Yes, KEHONG BIO provides custom synthesis services for 2,5-环己二烯-1,4-二亚胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.